| CAS Number | 1423031-89-3 |
| Catalog Number | AG01A1KA(AGN-PC-0WO0UO) |
| Chemical Name | Sodium 1-(prop-2-enoyl)piperidine-4-carboxylate |
| IUPAC Name | sodium;1-prop-2-enoylpiperidine-4-carboxylate |
| InChI | InChI=1S/C9H13NO3.Na/c1-2-8(11)10-5-3-7(4-6-10)9(12)13;/h2,7H,1,3-6H2,(H,12,13);/q;+1/p-1 |
| InChI Key | ZKHKNPJXQZZEAI-UHFFFAOYSA-M |
| MDL Number | MFCD22421872 |
| Molecular Formula | C9H12NNaO3 |
| Molecular Weight | 205.1863 |
| SMILES | C=CC(=O)N1CCC(CC1)C(=O)[O-].[Na+] |
| Synonyms | sodium 1-(prop-2-enoyl)piperidine-4-carboxylate,
1423031-89-3,
AKOS026726342,
MCULE-8953118399,
NE46733,
EN300-113909,
Z1480670571,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.189g/mol |
| Monoisotopic Mass | 205.071g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 60.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number